[2-[(4-iodanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl] pentanoate

Systemtic Name: [2-[(4-iodanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl] pentanoate Openeye Name: [2-(4-iodo-2-methyl-anilino)-2-oxo-ethyl] pentanoate CAS Name: pentanoic acid [2-(4-iodo-2-methylanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-iodo-2-methylanilino)-2-oxoethyl] pentanoate Traditional Name: valeric acid [2-(4-iodo-2-methyl-anilino)-2-keto-ethyl] ester Formula: C14H18INO3 MolecularWeight: 375.20209

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)OCC(=O)NC1=C(C=C(C=C1)I)C

Isomeric SMILES

CCCCC(=O)OCC(=O)NC1=C(C=C(C=C1)I)C

InChI

InChI=1S/C14H18INO3/c1-3-4-5-14(18)19-9-13(17)16-12-7-6-11(15)8-10(12)2/h6-8H,3-5,9H2,1-2H3,(H,16,17)